4-[[4-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-oxo-3-propyl-phthalazine-1-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-oxo-3-propylphthalazine-1-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4-keto-3-propyl-phthalazine-1-carbonyl)piperazino]methyl]benzonitrile Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H25N5O2/c1-2-11-29-23(30)21-6-4-3-5-20(21)22(26-29)24(31)28-14-12-27(13-15-28)17-19-9-7-18(16-25)8-10-19/h3-10H,2,11-15,17H2,1H3